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7-(2-fluorophenyl)-1-(2-furanylmethyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione
SpectraBase Compound ID 1Tp5jJapRKS
InChI InChI=1S/C19H11F7N4O3/c20-11-6-2-1-5-10(11)13-27-14-12(17(29-13,18(21,22)23)19(24,25)26)15(31)28-16(32)30(14)8-9-4-3-7-33-9/h1-7H,8H2,(H,27,29)(H,28,31,32)
InChIKey YVADYQVIPLKIPA-UHFFFAOYSA-N
Mol Weight 476.31 g/mol
Molecular Formula C19H11F7N4O3
Exact Mass 476.071937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BwUgEk1hLYJ
Name 7-(2-fluorophenyl)-1-(2-furanylmethyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione
Alternate Name(s) 7-(2-fluorophenyl)-1-(2-furfuryl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone 7-(2-fluorophenyl)-1-(2-furylmethyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione 7-(2-fluorophenyl)-1-(furan-2-ylmethyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione
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Formula C19H11F7N4O3
InChI InChI=1S/C19H11F7N4O3/c20-11-6-2-1-5-10(11)13-27-14-12(17(29-13,18(21,22)23)19(24,25)26)15(31)28-16(32)30(14)8-9-4-3-7-33-9/h1-7H,8H2,(H,27,29)(H,28,31,32)
InChIKey YVADYQVIPLKIPA-UHFFFAOYSA-N
Molecular Weight 476.311 g/mol
SMILES N1C(C=2C(N=C(NC2N(Cc2occc2)C1=O)c1c(F)cccc1)(C(F)(F)F)C(F)(F)F)=O
SPLASH splash10-001i-9100100000-29256e378a4e710aa1a4
Wiley ID 1442468